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TargetAcetylcholinesterase
LigandBDBM50146850
Substrate/Competitorn/a
Meas. Tech.ChEMBL_28138 (CHEMBL644922)
IC50>50000±n/a nM
Citation Meier, CDucho, CGörbig, UEsnouf, RBalzarini, J Interaction of cycloSal-pronucleotides with cholinesterases from different origins. A structure-activity relationship. J Med Chem47:2839-52 (2004) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Acetylcholinesterase
Name:Acetylcholinesterase
Synonyms:ACES_ELEEL | Acetylcholinesterase (AChE) | Acetylcholinesterase (EeAChE) | ache
Type:Enzyme
Mol. Mass.:71812.79
Organism:Electrophorus electricus (Electric eel)
Description:n/a
Residue:633
Sequence:
MKILDALLFPVIFIMFFIHLSIAQTDPELTIMTRLGQVQGTRLPVPDRSHVIAFLGIPFA
EPPLGKMRFKPPEPKKPWNDVFDARDYPSACYQYVDTSYPGFSGTEMWNPNRMMSEDCLY
LNVWVPATPRPHNLTVMVWIYGGGFYSGSSSLDVYDGRYLAHSEKVVVVSMNYRVSAFGF
LALNGSAEAPGNVGLLDQRLALQWVQDNIHFFGGNPKQVTIFGESAGAASVGMHLLSPDS
RPKFTRAILQSGVPNGPWRTVSFDEARRRAIKLGRLVGCPDGNDTDLIDCLRSKQPQDLI
DQEWLVLPFSGLFRFSFVPVIDGVVFPDTPEAMLNSGNFKDTQILLGVNQNEGSYFLIYG
APGFSKDNESLITREDFLQGVKMSVPHANEIGLEAVILQYTDWMDEDNPIKNREAMDDIV
GDHNVVCPLQHFAKMYAQYSILQGQTGTASQGNLGWGNSGSASNSGNSQVSVYLYMFDHR
ASNLVWPEWMGVIHGYEIEFVFGLPLEKRLNYTLEEEKLSRRMMKYWANFARTGNPNINV
DGSIDSRRRWPVFTSTEQKHVGLNTDSLKVHKGLKSQFCALWNRFLPRLLNVTENIDDAE
RQWKAEFHRWSSYMMHWKNQFDHYSKQERCTNL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50146850
n/a
NameBDBM50146850
Synonyms:5-Methyl-1-[5-(3-oxo-1H-2,4-dioxa-3lambda*5*-phospha-phenanthren-3-yloxymethyl)-2,5-dihydro-furan-2-yl]-1H-pyrimidine-2,4-dione | CHEMBL95375
TypeSmall organic molecule
Emp. Form.C21H19N2O7P
Mol. Mass.442.3585
SMILESCc1cn(C2OC(COP3(=O)OCc4ccc5ccccc5c4O3)C=C2)c(=O)[nH]c1=O |c:27|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: